⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL10069946 | 0.75 | TSHR (0.35) | — | |
| SCHEMBL5050689 | 0.73 | — | — | |
| SCHEMBL1276877 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL28873768 | 0.69 | — | — | |
| SCHEMBL21947356 | 0.69 | — | — | |
| SCHEMBL17607523 | 0.69 | — | — | |
| SCHEMBL13037043 | 0.69 | — | — | |
| SCHEMBL21064272 | 0.69 | — | — | |
| Iodide SCHEMBL28419244 | 0.69 | — | — | |
| Bromide SCHEMBL5978535 | 0.69 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120041314-A1 | ORGANIC PIEZOELECTRIC MATERIAL, ULTRASOUND PROBE, AND ULTRASOUND IMAGE DETECTOR | KONICA MINOLTA MEDICAL & GRAPHICS, INC. (JP) | 2012-02-16 | — | — | US | disclosed |